Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.85 |
| ▸ | CTSL | P07711 | 2/20 | 0.73 |
| ▸ | CTSB | P07858 | 2/20 | 0.73 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.72 |
| ▸ | CA1 | P00915 | 2/20 | 0.68 |
| ▸ | CA2 | P00918 | 2/20 | 0.68 |
| ▸ | KRAS | P01116 | 1/20 | 0.64 |
| ▸ | SNCA | P37840 | 2/20 | 0.63 |
| ▸ | DPP4 | P27487 | 3/20 | 0.61 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.59 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.56 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7189059 | 0.90 | ABCG2 (0.69) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL7189052 | 0.90 | ABCG2 (0.69) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL7185085 | 0.87 | ABCG2 (0.64) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL7185074 | 0.87 | ABCG2 (0.64) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL28561663 | 0.87 | ABCG2 (0.88) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL15155043 | 0.87 | ABCG2 (0.88) | ABCG2PTPN1KRASSNCADPP4 | |
| SCHEMBL15155042 | 0.87 | ABCG2 (0.88) | ABCG2PTPN1KRASSNCADPP4 | |
| SCHEMBL7184180 | 0.85 | PTPN1 (0.76) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL7184183 | 0.85 | PTPN1 (0.76) | ABCG2CTSLCTSBPTPN1CA1 | |
| SCHEMBL7188207 | 0.85 | ABCG2 (0.61) | ABCG2CTSLCTSBPTPN1CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003097577-A1 | CHEMICAL COMPOUND CONSISTING OF A NITROGENOUS CHALCONE DERIVATIVE, METHOD OF PRODUCING ONE SUCH CHEMICAL COMPOUND AND FILTERING AND/OR COSMETIC COMPOSITION CONTAINING SAME | SYNTH'E163 (SOCIETE ANONYME) (FR) | 2003-11-27 | — | — | WO | claimed |
| WO-2003097577-A1 | CHEMICAL COMPOUND CONSISTING OF A NITROGENOUS CHALCONE DERIVATIVE, METHOD OF PRODUCING ONE SUCH CHEMICAL COMPOUND AND FILTERING AND/OR COSMETIC COMPOSITION CONTAINING SAME | SYNTH'E163 (SOCIETE ANONYME) (FR) | 2003-11-27 | — | — | WO | disclosed |